SCHEMBL3407799

SCHEMBL3407799

CN1CCN(Cc2ccc3c(ccn3S(=O)(=O)c3ccccc3)c2)CC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 20/20 1.00
CHRM1 P11229 1/20 0.61
CYP3A4 P08684 1/20 0.60
CYP2D6 P10635 1/20 0.60
HTR1A P08908 1/20 0.57
DRD2 P14416 1/20 0.57

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Hydrochloric Acid SCHEMBL3217522 0.99 HTR6 (0.98) HTR6CHRM1CYP3A4CYP2D6HTR1A
SCHEMBL3411710 0.91 HTR6 (0.83) HTR6CHRM1
SCHEMBL3209765 0.90 HTR6 (0.83) HTR6CHRM1
Hydrochloric Acid SCHEMBL3209863 0.90 HTR6 (0.81) HTR6CHRM1
SCHEMBL3222022 0.89 HTR6 (1.00) HTR6
SCHEMBL3209681 0.89 HTR6 (1.00) HTR6
SCHEMBL3200826 0.87 HTR6 (0.77) HTR6CYP3A4CYP2D6
SCHEMBL3221120 0.87 HTR6 (1.00) HTR6CYP3A4CYP2D6
SCHEMBL3407441 0.86 HTR6 (1.00) HTR6CHRM1CYP3A4
SCHEMBL3407154 0.85 HTR6 (1.00) HTR6CHRM1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2114878-B1 5-(HETEROCYCLYL)ALKYL-N-(ARYLSULFONYL)INDOLE COMPOUNDS AND THEIR USE AS 5-HT6 LIGANDS SUVEN LIFE SCIENCES LTD (IN) 2010-12-15 EP claimed